[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)propanoate

Systemtic Name: [2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)propanoate Openeye Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl] 3-(2-chlorophenyl)propanoate CAS Name: 3-(2-chlorophenyl)propanoic acid [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 3-(2-chlorophenyl)propanoate Traditional Name: 3-(2-chlorophenyl)propionic acid [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl] ester Formula: C20H18ClNO6 MolecularWeight: 403.81302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)COC(=O)CCC3=CC=CC=C3Cl)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)COC(=O)CCC3=CC=CC=C3Cl)OCO2

InChI

InChI=1S/C20H18ClNO6/c1-12(23)14-8-17-18(28-11-27-17)9-16(14)22-19(24)10-26-20(25)7-6-13-4-2-3-5-15(13)21/h2-5,8-9H,6-7,10-11H2,1H3,(H,22,24)